SCHEMBL25891673

SCHEMBL25891673

Cc1cccc(C=C(F)F)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ TAS1R2 Q8TE23 1/20 0.32
▸ TRPA1 O75762 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MPI P34949 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24832676 0.79 ALDH1A1 (0.50) ALDH1A1TSHRMEN1KMT2AKDM4E
SCHEMBL16958755 0.77 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2ATAS1R3
SCHEMBL30340515 0.76 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ATAS1R3TAS1R1
SCHEMBL21622907 0.76 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ATAS1R3TAS1R1
SCHEMBL21949128 0.76 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2ATAS1R3
SCHEMBL25891666 0.74 — —
SCHEMBL3716770 0.74 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2ATAS1R3
SCHEMBL3686691 0.72 ALDH1A1 (0.48) ALDH1A1TSHRMEN1KMT2ATAS1R3
SCHEMBL5313673 0.72 ALDH1A1 (0.60) ALDH1A1TSHRMEN1KMT2AKDM4E
SCHEMBL16953345 0.71 ALDH1A1 (0.37) ALDH1A1TSHRMEN1KMT2ATAS1R3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-07-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF CD274, PDCD1, PDCD1LG2 ALDH1A1 106/4885TSHR 2147/4885MEN1 524/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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